Article
Probing fragment complementation by rigid-body docking: in silico reconstitution of calbindin D9k.
Journal of chemical information and modeling - 1 Jan 2000
Dell'Orco Daniele, Seeber Michele, De Benedetti Pier Giuseppe, Fanelli Francesca
Abstract excerpt
Fragment complementation is gaining an increasing impact as a nonperturbing method to probe noncovalent interactions within protein supersecondary structures. In this study, the fast Fourier transform rigid-body docking algorithm ZDOCK has been employed for in silico reconstitution of the calcium binding protein calbindin D9k, from its two EF-hands subdomains, namely, EF1 (residues 1-43) and EF2 (residues 44-75)....
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